SCHEMBL27166351

SCHEMBL27166351

CCCCCCCCCCC#Cn1ccc(C(=O)O)n1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PLA2G4A P47712 1/20 0.41
PTPN7 P35236 4/20 0.41
HMGCR P04035 2/20 0.41
FFAR1 O14842 1/20 0.39
FFAR4 Q5NUL3 1/20 0.39
MMP2 P08253 1/20 0.39
MMP12 P39900 1/20 0.39
RECQL P46063 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
HCAR2 Q8TDS4 1/20 0.37

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL27793505 0.70 PLA2G4A (0.52) PLA2G4ATDP1HCAR2
Bicarbonate SCHEMBL15967903 0.65 PTPN7 (0.75) PTPN7HMGCRFFAR1FFAR4RECQL
Bicarbonate SCHEMBL15967688 0.65 PTPN7 (0.75) PTPN7HMGCRFFAR1FFAR4RECQL
Bicarbonate SCHEMBL15967786 0.65 PTPN7 (0.75) PTPN7HMGCRFFAR1FFAR4RECQL
SCHEMBL167425 0.64 SMN1; SMN2 (0.49) PLA2G4A
SCHEMBL2383963 0.64 MGLL (0.48) PTPN7HMGCRFFAR1FFAR4RECQL
SCHEMBL932824 0.63 ALDH1A1 (0.55) PLA2G4A
SCHEMBL6746703 0.63 NOS1 (0.37) PTPN7HMGCR
SCHEMBL30143434 0.63 MMP2 (0.72) PLA2G4AFFAR1FFAR4MMP2MMP12
SCHEMBL6934491 0.63 MMP2 (0.72) PLA2G4AFFAR1FFAR4MMP2MMP12

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4334307-A1 CDK2 DEGRADERS AND USES THEREOF Kymera Therapeutics, Inc. (US) 2024-03-13 EP disclosed